2OZ1

the soxax complex of rhodovulum sulfidophilum

• Total interactions analyzed: 28
• Total true interactions: 13
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 101
  • Norm. En. per Res.: -5.5367
• Hub Node: C(4)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-103.9521	-39.6693	-415.587	-559.2084	101	21	6	14657	2	19	21
A-C	0.0	0.0	-0.4895	-0.4895	16	0	0	112	0	4	2
A-E	-17.9579	-80.5368	-85.2942	-183.7889	51	1	2	3622	7	39	20
B-C	-31.6401	9.7006	-81.4265	-103.366	28	3	0	2561	0	11	8
B-E	0.0	-54.8846	-81.5626	-136.4472	54	7	2	3681	2	16	17
B-F	0.0	0.0	-2.0413	-2.0413	3	0	0	88	0	0	0
C-D	-112.2595	-9.8793	-396.255	-518.3937	102	14	5	14136	1	20	18
C-F	0.0	8.0848	-19.1585	-11.0737	21	0	0	736	0	9	7
C-G	-23.0064	-78.5843	-80.6074	-182.1982	52	6	2	3479	7	40	17
C-H	-7.6362	-41.042	-79.6451	-128.3233	54	4	1	3570	1	18	24
D-H	0.0	0.0	-0.8923	-0.8923	4	0	0	63	0	0	0
E-F	-98.6668	-3.3068	-406.235	-508.2086	102	15	6	14425	1	20	18
G-H	-104.3967	-42.9357	-405.303	-552.6354	101	13	6	14486	3	19	21

Interface residues

• A-B: ALA107B, ALA178A, ALA191A, ALA232A, ALA44B, ALA52B, ALA94B, ARG103B, ARG118B, ARG169A, ARG190A, ARG220A, ARG224A, ARG227A, ARG37B, ARG97B, ASN102B, ASN41B, ASP174A, ASP186A, ASP192A, ASP225A, ASP36B, CYS180A, CYS42B, CYS45B, GLN172A, GLN183A, GLN55B, GLU164A, GLU237A, GLU89B, GLU99B, GLY100B, GLY105B, GLY171A, GLY221A, GLY228A, GLY40B, GLY58B, GLY61B, HIS181A, HIS187A, HIS193A, HIS46B, ILE106B, ILE113B, ILE117B, ILE165A, ILE189A, ILE223A, ILE43B, LEU120B, LEU173A, LEU175A, LEU194A, LYS111B, LYS208A, LYS84B, MET121B, MET34B, MET51B, MET92B, PHE101B, PHE108B, PHE185A, PHE231A, PHE238A, PHE56B, PHE87B, PRO104B, PRO112B, PRO119B, PRO230A, PRO57B, PRO62B, PRO88B, PRO93B, SER110B, SER176A, SER179A, SER235A, SER38B, SER83B, THR109B, THR168A, THR226A, THR35B, THR39A, THR59B, THR90B, TYR170A, TYR184A, TYR188A, TYR95B, TYR96B, VAL229A, VAL39B, VAL60B, VAL91B, VAL98B
• A-C: ALA101C, ALA232A, ARG118C, ARG169A, GLN172A, GLU164A, GLU99C, GLY102C, GLY171A, LYS103C, PHE231A, SER100C, SER117C, THR168A, TYR170A, VAL229A
• A-E: ALA191A, ALA210A, ALA44E, ARG190A, ARG206A, ARG211A, ARG220A, ARG224A, ASN209A, ASN213A, ASN261A, ASN52E, ASN9E, ASP192A, ASP217A, ASP225A, ASP3E, ASP40E, ASP41E, ASP48E, ASP49E, ASP4E, GLN43E, GLU11E, GLU13E, GLU46E, GLU51E, GLU59E, GLY10E, GLY1E, GLY221A, ILE127A, ILE189A, ILE8E, LEU207A, LEU212A, LEU45E, LEU6E, LYS208A, MET47E, PHE50E, PHE57A, PRO129A, PRO230A, PRO5E, THR39E, THR42E, TRP35E, TYR205A, VAL56E, VAL7E
• B-C: ALA101C, ALA155C, ARG103B, ARG118C, ARG97B, ASN102B, ASP152C, GLU114B, GLU116B, GLU99B, GLU99C, GLY100B, GLY102C, GLY105B, GLY115B, GLY153C, ILE113B, ILE117B, LYS103C, PHE101B, PRO104B, PRO112B, PRO154C, SER100C, SER117C, TYR97C, VAL98B, VAL98C
• B-E: ALA107B, ALA191E, ALA210E, ALA44B, ALA44E, ALA52B, ALA61E, ALA63E, ARG211E, ARG31B, ARG32B, ARG37B, ARG62E, ARG67E, ASN41B, ASN52E, ASN9E, ASP36B, ASP40E, ASP41E, ASP48E, ASP49E, GLN125B, GLN55B, GLU29B, GLU51E, GLU59E, GLU60E, GLY54E, ILE106B, ILE43B, LEU207E, LEU212E, LEU33B, LEU45E, LYS111B, MET34B, MET55E, PHE108B, PHE50E, PHE56B, PHE57E, PRO57B, SER110B, SER38B, SER53E, THR109B, THR35B, THR39E, THR42E, TYR205E, VAL28B, VAL39B, VAL56E
• B-F: GLN55F, LYS111B, PHE56F
• C-D: ALA107D, ALA178C, ALA191C, ALA232C, ALA44D, ALA54D, ALA94D, ARG103D, ARG118D, ARG169C, ARG190C, ARG220C, ARG224C, ARG227C, ARG37D, ARG97D, ASN102D, ASN41D, ASN82D, ASP174C, ASP186C, ASP192C, ASP225C, ASP36D, ASP53D, CYS180C, CYS42D, CYS45D, GLN172C, GLN183C, GLN55D, GLU114D, GLU237C, GLU89D, GLU99D, GLY100D, GLY105D, GLY171C, GLY221C, GLY228C, GLY40D, GLY58D, GLY61D, HIS181C, HIS187C, HIS193C, HIS46D, ILE106D, ILE113D, ILE117D, ILE165C, ILE189C, ILE223C, ILE43D, LEU120D, LEU173C, LEU175C, LEU194C, LYS111D, LYS208C, LYS84D, MET121D, MET34D, MET92D, PHE101D, PHE108D, PHE185C, PHE231C, PHE238C, PHE56D, PHE87D, PRO104D, PRO112D, PRO119D, PRO230C, PRO57D, PRO62D, PRO88D, PRO93D, SER110D, SER176C, SER179C, SER235C, SER38D, SER83D, THR109D, THR168C, THR226C, THR35D, THR59D, THR90D, TYR167C, TYR170C, TYR184C, TYR188C, TYR95D, TYR96D, VAL229C, VAL39D, VAL60D, VAL91D, VAL98D
• C-F: ALA52F, ALA54F, ALA75C, ALA77C, ALA82C, ARG31F, ASP53F, ASP78C, CYS79C, GLN55F, GLU50F, GLU72C, GLY73C, GLY81C, HIS80C, LYS74C, MET51F, PHE56F, PRO57F, PRO68C, THR49F
• C-G: ALA191G, ALA210G, ALA44C, ARG190G, ARG206G, ARG211G, ARG218G, ARG220G, ARG224G, ASN209G, ASN213G, ASN261G, ASN52C, ASN9C, ASP192G, ASP217G, ASP225G, ASP3C, ASP40C, ASP41C, ASP48C, ASP49C, ASP4C, GLN43C, GLU11C, GLU13C, GLU46C, GLU51C, GLU59C, GLY10C, GLY1C, GLY221G, ILE127G, ILE189G, ILE8C, LEU207G, LEU45C, LEU6C, LYS208G, MET47C, MET55C, PHE50C, PHE57G, PRO129G, PRO230G, PRO5C, THR39C, THR42C, TRP35C, TYR205G, VAL56C, VAL7C
• C-H: ALA107H, ALA191C, ALA210C, ALA44C, ALA44H, ALA54H, ALA63C, ARG211C, ARG31H, ARG32H, ARG37H, ARG62C, ARG67C, ASN41H, ASN52C, ASN9C, ASP36H, ASP40C, ASP41C, ASP48C, ASP49C, ASP53H, ASP66C, GLN125H, GLN55H, GLU29H, GLU51C, GLU59C, GLU60C, GLY54C, ILE106H, ILE43H, LEU207C, LEU33H, LEU45C, LYS111H, MET34H, MET55C, PHE108H, PHE50C, PHE56H, PHE57C, PRO129C, SER110H, SER38H, SER53C, THR109H, THR35H, THR39C, THR42C, TYR205C, VAL28H, VAL39H, VAL56C
• D-H: GLN55D, GLU114H, LYS111H, PHE56D
• E-F: ALA107F, ALA178E, ALA191E, ALA232E, ALA44F, ALA54F, ALA94F, ARG103F, ARG118F, ARG169E, ARG190E, ARG220E, ARG224E, ARG227E, ARG37F, ARG97F, ASN102F, ASN41F, ASN82F, ASP174E, ASP186E, ASP192E, ASP225E, ASP36F, ASP53F, CYS180E, CYS42F, CYS45F, GLN172E, GLN183E, GLN55F, GLU182E, GLU237E, GLU89F, GLU99F, GLY100F, GLY105F, GLY171E, GLY221E, GLY228E, GLY40F, GLY58F, GLY61F, HIS181E, HIS187E, HIS193E, HIS46F, ILE106F, ILE113F, ILE117F, ILE165E, ILE189E, ILE223E, ILE43F, LEU120F, LEU173E, LEU175E, LEU194E, LYS111F, LYS84F, MET121F, MET34F, MET92F, PHE101F, PHE108F, PHE185E, PHE231E, PHE238E, PHE56F, PHE87F, PRO104F, PRO112F, PRO119F, PRO230E, PRO57F, PRO5F, PRO62F, PRO88F, PRO93F, SER110F, SER176E, SER179E, SER235E, SER38F, SER83F, THR109F, THR168E, THR226E, THR35F, THR59F, THR90F, TYR167E, TYR170E, TYR184E, TYR188E, TYR95F, TYR96F, VAL229E, VAL39F, VAL60F, VAL91F, VAL98F
• G-H: ALA107H, ALA178G, ALA191G, ALA232G, ALA44H, ALA54H, ALA94H, ARG103H, ARG118H, ARG169G, ARG190G, ARG220G, ARG224G, ARG227G, ARG37H, ARG97H, ASN102H, ASN41H, ASP174G, ASP186G, ASP192G, ASP225G, ASP36H, ASP53H, CYS180G, CYS42H, CYS45H, GLN172G, GLN183G, GLN55H, GLU164G, GLU237G, GLU47H, GLU89H, GLU99H, GLY100H, GLY105H, GLY171G, GLY221G, GLY228G, GLY40H, GLY58H, GLY61H, HIS187G, HIS193G, HIS46H, ILE106H, ILE113H, ILE117H, ILE165G, ILE189G, ILE223G, ILE43H, LEU120H, LEU173G, LEU175G, LEU194G, LYS111H, LYS208G, LYS84H, MET121H, MET34H, MET92H, PHE101H, PHE108H, PHE185G, PHE231G, PHE238G, PHE56H, PHE87H, PRO104H, PRO112H, PRO119H, PRO230G, PRO57H, PRO62H, PRO88H, PRO93H, SER110H, SER176G, SER179G, SER235G, SER38H, SER83H, THR109H, THR168G, THR226G, THR35H, THR39G, THR59H, THR90H, TYR170G, TYR184G, TYR188G, TYR95H, TYR96H, VAL229G, VAL39H, VAL60H, VAL91H, VAL98H